Using device 0 (rank 0, local rank 0, local size 1) : Tesla V100-PCIE-16GB
running on 1 total cores
distrk: each k-point on 1 cores, 1 groups
distr: one band on 1 cores, 1 groups
*******************************************************************************
You are running the GPU port of VASP! When publishing results obtained with
this version, please cite:
- M. Hacene et al., http://dx.doi.org/10.1002/jcc.23096
- M. Hutchinson and M. Widom, http://dx.doi.org/10.1016/j.cpc.2012.02.017
in addition to the usual required citations (see manual).
GPU developers: A. Anciaux-Sedrakian, C. Angerer, and M. Hutchinson.
*******************************************************************************
-----------------------------------------------------------------------------
| |
| W W AA RRRRR N N II N N GGGG !!! |
| W W A A R R NN N II NN N G G !!! |
| W W A A R R N N N II N N N G !!! |
| W WW W AAAAAA RRRRR N N N II N N N G GGG ! |
| WW WW A A R R N NN II N NN G G |
| W W A A R R N N II N N GGGG !!! |
| |
| Please note that VASP has recently been ported to GPU by means of |
| OpenACC. You are running the CUDA-C GPU-port of VASP, which is |
| deprecated and no longer actively developed, maintained, or |
| supported. In the near future, the CUDA-C GPU-port of VASP will be |
| dropped completely. We encourage you to switch to the OpenACC |
| GPU-port of VASP as soon as possible. |
| |
-----------------------------------------------------------------------------
vasp.6.2.1 16May21 (build Apr 11 2022 11:03:26) complex
MD_VERSION_INFO: Compiled 2022-04-11T18:25:55-UTC in devlin.sd.materialsdesign.
com:/home/medea2/data/build/vasp6.2.1/16685/x86_64/src/src/build/gpu from svn 1
6685
This VASP executable licensed from Materials Design, Inc.
POSCAR found type information on POSCAR SiH O
POSCAR found : 3 types and 35 ions
-----------------------------------------------------------------------------
| |
| W W AA RRRRR N N II N N GGGG !!! |
| W W A A R R NN N II NN N G G !!! |
| W W A A R R N N N II N N N G !!! |
| W WW W AAAAAA RRRRR N N N II N N N G GGG ! |
| WW WW A A R R N NN II N NN G G |
| W W A A R R N N II N N GGGG !!! |
| |
| You use a magnetic or noncollinear calculation, but did not specify |
| the initial magnetic moment with the MAGMOM tag. Note that a |
| default of 1 will be used for all atoms. This ferromagnetic setup |
| may break the symmetry of the crystal, in particular it may rule |
| out finding an antiferromagnetic solution. Thence, we recommend |
| setting the initial magnetic moment manually or verifying carefully |
| that this magnetic setup is desired. |
| |
-----------------------------------------------------------------------------
NWRITE = 1
LDA part: xc-table for Pade appr. of Perdew
WARNING: The GPU port of VASP has been extensively
tested for: ALGO=Normal, Fast, and VeryFast.
Other algorithms may produce incorrect results or
yield suboptimal performance. Handle with care!
POSCAR, INCAR and KPOINTS ok, starting setup
creating 32 CUDA streams...
creating 32 CUFFT plans with grid size 54 x 96 x 40...
FFT: planning ...
WAVECAR not read
entering main loop
N E dE d eps ncg rms rms(c)
DAV: 1 0.608186342088E+03 0.60819E+03 -0.38984E+04 1664 0.788E+02
DAV: 2 -0.875960914875E+02 -0.69578E+03 -0.66054E+03 2248 0.168E+02
DAV: 3 -0.162860738302E+03 -0.75265E+02 -0.73500E+02 2128 0.535E+01
DAV: 4 -0.165914593488E+03 -0.30539E+01 -0.30327E+01 2240 0.123E+01
DAV: 5 -0.166054144814E+03 -0.13955E+00 -0.13948E+00 2392 0.259E+00 0.253E+01
DAV: 6 -0.119573305460E+04 -0.10297E+04 -0.78585E+03 2040 0.184E+01 0.711E+01
DAV: 7 -0.125342494433E+03 0.10704E+04 -0.56831E+03 1928 0.127E+02 0.204E+01
DAV: 8 -0.127290290511E+03 -0.19478E+01 -0.42600E+01 2000 0.121E+01 0.117E+01
DAV: 9 -0.139817779541E+03 -0.12527E+02 -0.25289E+01 2024 0.735E+00 0.908E+00
DAV: 10 -0.145610898888E+03 -0.57931E+01 -0.67309E+00 2128 0.387E+00 0.702E+00
DAV: 11 -0.117257352571E+05 -0.11580E+05 -0.10853E+05 2496 0.477E+01 0.646E+01
DAV: 12 -0.131061988975E+03 0.11595E+05 -0.49882E+03 1856 0.590E+01 0.161E+01
DAV: 13 -0.152507136892E+03 -0.21445E+02 -0.91698E+01 2072 0.136E+01 0.547E+00
DAV: 14 -0.160170971083E+03 -0.76638E+01 -0.12100E+01 2128 0.532E+00 0.525E+00
DAV: 15 -0.163324939415E+03 -0.31540E+01 -0.16802E+00 2104 0.276E+00 0.450E+00
DAV: 16 -0.167866774793E+03 -0.45418E+01 -0.53051E+00 1992 0.472E+00 0.368E+00
DAV: 17 -0.165987687182E+03 0.18791E+01 -0.29159E+03 1816 0.207E+02 0.811E+00
DAV: 18 -0.171342223757E+03 -0.53545E+01 -0.72636E+00 2160 0.184E+00 0.394E+00
DAV: 19 -0.172455217325E+03 -0.11130E+01 -0.27821E+00 1952 0.185E+00 0.314E+00
DAV: 20 -0.176171239592E+03 -0.37160E+01 -0.76357E+00 2152 0.245E+00 0.505E+00
DAV: 21 -0.173711914567E+03 0.24593E+01 -0.65612E+00 1920 0.169E+00 0.294E+00
DAV: 22 -0.173804210190E+03 -0.92296E-01 -0.22832E-01 1848 0.765E-01 0.273E+00
DAV: 23 -0.174141528646E+03 -0.33732E+00 -0.43303E-02 2096 0.418E-01 0.259E+00
DAV: 24 -0.174034073551E+03 0.10746E+00 -0.14143E-02 2192 0.250E-01 0.251E+00
DAV: 25 -0.131691921383E+04 -0.11429E+04 -0.10406E+04 2032 0.164E+01 0.696E+01
DAV: 26 -0.166712200444E+03 0.11502E+04 -0.43148E+03 1784 0.381E+01 0.111E+01
DAV: 27 -0.174530607576E+03 -0.78184E+01 -0.10300E+01 2112 0.405E+00 0.331E+00
DAV: 28 -0.173226346394E+03 0.13043E+01 -0.17278E+00 1888 0.210E+00 0.238E+00
DAV: 29 -0.174040375334E+03 -0.81403E+00 -0.64858E-01 2024 0.884E-01 0.243E+00
DAV: 30 -0.248060699486E+04 -0.23066E+04 -0.21682E+04 2976 0.179E+01 0.833E+01
DAV: 31 -0.166821990495E+03 0.23138E+04 -0.72669E+03 2200 0.731E+01 0.165E+01
DAV: 32 -0.803249398789E+04 -0.78657E+04 -0.72766E+04 3232 0.529E+01 0.894E+01
DAV: 33 -0.157060938472E+03 0.78754E+04 -0.99774E+03 1760 0.114E+02 0.196E+01
DAV: 34 -0.167203061344E+03 -0.10142E+02 -0.40552E+02 2184 0.416E+01 0.807E+00
DAV: 35 -0.288827638618E+03 -0.12162E+03 -0.10608E+03 2584 0.521E+00 0.537E+01
DAV: 36 -0.342656149193E+06 -0.34237E+06 -0.33710E+06 2728 0.167E+03 0.140E+02
DAV: 37 -0.100254931428E+03 0.34256E+06 -0.73879E+03 2048 0.617E+01 0.306E+01
DAV: 38 -0.162710203277E+03 -0.62455E+02 -0.39637E+02 2264 0.269E+01 0.781E+00
DAV: 39 -0.168936418863E+03 -0.62262E+01 -0.98182E+01 2184 0.114E+01 0.526E+00
DAV: 40 -0.173630026473E+03 -0.46936E+01 -0.13022E+01 2184 0.408E+00 0.360E+00
DAV: 41 -0.173793734680E+03 -0.16371E+00 -0.95019E-01 2216 0.128E+00 0.332E+00
DAV: 42 -0.173945708879E+03 -0.15197E+00 -0.28063E-02 2208 0.329E-01 0.321E+00
DAV: 43 -0.174099246914E+03 -0.15354E+00 -0.11666E-02 2064 0.202E-01 0.307E+00
DAV: 44 -0.174156992742E+03 -0.57746E-01 -0.10664E-02 2032 0.204E-01 0.282E+00
DAV: 45 -0.537280722312E+04 -0.51987E+04 -0.47470E+04 2752 0.597E+01 0.771E+01
DAV: 46 -0.812599382350E+04 -0.27532E+04 -0.48526E+04 2376 0.197E+02BRMIX: very serious problems
the old and the new charge density differ
old charge density: 136.00000 new 136.35232
0.101E+02
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-1.411511620904386E-005
DAV: 47 -0.404805423211E+03 0.77212E+04 -0.11490E+04 2128 0.111E+02BRMIX: very serious problems
the old and the new charge density differ
old charge density: 136.35232 new 136.83992
0.239E+01
DAV: 48 -0.970232351856E+03 -0.56543E+03 -0.18637E+02 2256 0.179E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 136.83992 new 137.40179
0.790E+00
DAV: 49 -0.890566060277E+04 -0.79354E+04 -0.17825E+02 2200 0.121E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 137.40179 new 136.40480
0.499E+01
DAV: 50 -0.482769922433E+04 0.40780E+04 -0.37965E+02 2208 0.128E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 136.40480 new 135.16205
0.324E+01
DAV: 51 -0.160204604615E+05 -0.11193E+05 -0.38191E+02 2072 0.131E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 135.16205 new 134.48242
0.739E+01
DAV: 52 -0.155818066165E+05 0.43865E+03 -0.44522E+02 2160 0.145E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 134.48242 new 136.44832
0.652E+01
DAV: 53 -0.392125862879E+05 -0.23631E+05 -0.13632E+05 2064 0.209E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 136.44832 new 133.04707
0.926E+01
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
1.681719746003531E-005
DAV: 54 -0.628263521812E+04 0.32930E+05 -0.44439E+04 1952 0.180E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 133.04707 new 134.20506
0.272E+01
DAV: 55 -0.354136040104E+05 -0.29131E+05 -0.30537E+05 2024 0.183E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 134.20506 new 132.88401
0.287E+01
DAV: 56 -0.866758530461E+03 0.34547E+05 -0.66783E+02 1912 0.145E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 132.88401 new 133.72104
0.113E+01
DAV: 57 -0.211808087762E+05 -0.20314E+05 -0.20376E+05 1912 0.259E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 133.72104 new 134.85782
0.460E+02
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-3.120477739513920E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.047459863783931E-003
DAV: 58 -0.161104011188E+06 -0.13992E+06 -0.13114E+06 2040 0.327E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 134.85782 new 133.72238
0.460E+02
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.472037218159627E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-5.471143126332215E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
3.056114120633117E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.275526684485385E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-4.487856076785258E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
5.068060295085062E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.276337193239007E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-4.196181793445212E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-5.793913812084369E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
1.198817209840295E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-1.269772796798287E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
1.680485873194384E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
3.024207741229375E-004
DAV: 59 -0.104636338724E+04 0.16006E+06 -0.12518E+03 1912 0.244E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 133.72238 new 134.16672
0.585E+01
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-8.374972079072894E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-3.858566840626001E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-3.621548135570523E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.361145962988876E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-5.806379897630401E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
2.220563685610492E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.598630561586323E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-1.787836925095393E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-1.090933705130964E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-2.603846392489862E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.116278822553442E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.596320574965120E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
2.165322475725109E-005
DAV: 60 -0.317082016157E+06 -0.31604E+06 -0.19240E+06 2296 0.259E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 134.16672 new 133.12845
0.764E+01
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
4.672898028761487E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.348380270078848E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
1.097609179197814E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
2.338475710240462E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-8.905987807536832E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.388623744229875E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
2.813595647125799E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
3.299564771940356E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.370656746938246E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-2.126555620622940E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-2.899024487148052E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
3.562499567393692E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
1.201245144786296E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
2.147462775828676E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
1.523780030953687E-002
DAV: 61 -0.125467611089E+04 0.31583E+06 -0.10540E+03 1920 0.203E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 133.12845 new 132.08644
0.193E+01
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-1.634858572512855E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-2.541038680196437E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.544162285398032E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
1.195376756860161E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
2.033250233747105E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
1.638939072931867E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
2.541870219526896E-002
DAV: 62 -0.879283571657E+05 -0.86674E+05 -0.27647E+05 2272 0.265E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 132.08644 new 132.96094
0.873E+02
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
6.083655274736740E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
7.582337883992204E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-7.554875242756728E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
2.343563214337568E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
5.594872731908134E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
6.962451040044812E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
5.074209812732876E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-5.757169601737319E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
4.683490877572187E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
2.854619375886051E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-4.150937278834178E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
3.093538771761964E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
4.050461511361689E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-1.130479813459859E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-4.341643585474508E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
5.096818183444953E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.351597908735371E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.117832543945735E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.817738132893519E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
4.903528408136005E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
8.759156294826557E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.177723187758510E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
5.839589338485305E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
1.581640921507019E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.960186361249346E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-1.692314474774786E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-8.834765132747351E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-2.527555575328047E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-7.227291692004472E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.240179436946514E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
1.779439958982158E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.730278422540928E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.526690826415580E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-2.137548487557034E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.786911744355808E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-3.772372379548195E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-1.559173129058734E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-2.601356228286401E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.774739264447193E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-2.152635743526486E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
5.975619608510796E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.071052162499992E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-7.664853611744980E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-7.689404771155728E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-4.742231859765227E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.920745395601717E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-9.885909090370635E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-5.910789139980889E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-2.876559038586930E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.840240311071129E-002
DAV: 63 -0.123630276605E+04 0.86692E+05 -0.16810E+03 1920 0.275E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 132.96094 new 134.55857
0.638E+01
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-3.059600246772915E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-2.677252879583026E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.068209692720191E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.974313342734788E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-9.679693287796925E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.658337632287398E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.653321601997967E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-9.976132176150880E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
3.848722886170125E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-9.400593283284997E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
9.216606243855110E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
3.705200012415601E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
5.020799894444284E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.408117686750826E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.928698302183335E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-2.978068816759360E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.347340053946949E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-9.758477302684180E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-2.174099670624037E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.047397044120062E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.269938741091282E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-1.732516337131669E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
4.472304115470376E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-4.842067592249065E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.547283915673924E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-2.124314776695813E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.189020023563784E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-3.565275919835073E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-2.434373919566297E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-1.486561749232421E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-1.436752155109323E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-4.720398129245763E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-3.690044251409210E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-2.524841705343580E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-1.365045557264254E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-2.409825494437596E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-3.458013417560592E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-5.702069513844159E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-5.595515354953846E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.468620203845458E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-3.583656540869809E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.552079152357956E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-1.913486660115275E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-1.757960398107710E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-1.387350743816661E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-4.308652270877097E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-2.290933583878953E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-1.470149572239603E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-2.281896069671703E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-2.804412729381687E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-1.827685500371779E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-2.432699890302714E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-4.673980404022710E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-2.824897367722649E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-2.095949847254546E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-7.609907386805916E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-2.045423286419204E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.692382377443572E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-3.264041127983974E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-2.512827258857100E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-1.770126479081433E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-1.894000021791919E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-4.301573353537484E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-2.237188747886698E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-3.351729319774104E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-1.717961885310174E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.257281540004940E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
2.569596878903293E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.583382159310290E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-9.189158173115476E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-2.659719110291609E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-4.089927570482804E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-6.511076207169246E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-1.254434593439842E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-2.403402563978501E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-3.221672349643676E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
1.063508899757356E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-2.077216752003207E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-3.466069028194564E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-1.556365520328413E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-4.664910461960754E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-4.395822679363376E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-5.546135466924694E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.899176240334019E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.451516820971716E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.040717637621211E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-1.670108762693798E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-2.619930507603993E-002
DAV: 64 -0.123624689305E+07 -0.12350E+07 -0.70346E+06 2024 0.229E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 134.55857 new 134.91630
0.122E+02
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.567283560051727E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
5.912782484009768E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-8.046810437324501E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
2.667847570757608E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.206617239044161E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
1.802803699705867E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
1.145552864230730E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
6.702485388871122E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-6.442671437258070E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-3.065293284126191E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-1.611935222452459E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.908622323114464E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-2.305734888538469E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.895340442464964E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-2.359043778429956E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-1.819242634162790E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
7.774980387578955E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-1.538232838725396E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-4.179561552630390E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-7.476298010291938E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.148627387462940E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-9.670726937939429E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.016709953992956E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-8.564826925374617E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.912085115599829E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-3.114771572606460E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.359156787742097E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-1.408631186384389E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-2.876744309566162E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-1.363752723315831E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-2.450882606583211E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-1.351700908536510E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
2.254040508778176E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-4.478366021136449E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
2.649167589449936E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-4.491712916066522E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-6.386134333168883E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
4.732427787219298E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.358818860615656E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-2.330802904329400E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
5.745033106923313E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.095082750542092E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.008390232001548E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
7.834381184241933E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.248099242550466E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.112880710986632E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-3.034730303548382E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-8.878600414278805E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.378646214466982E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-3.635092288086177E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-8.852513748823600E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-7.341809036955291E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-8.488341038199173E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-2.205854941033292E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.315288432607960E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.323043412397988E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-1.812665955199814E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.678322409937243E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-2.320652707559391E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-4.151919187964687E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.581701778554492E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-2.452432184694071E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-5.450391958454334E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-2.524304599390798E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-3.402436428416874E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.414446806852431E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-1.129802484731528E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.467943505282566E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.469658948608210E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.099387229552503E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-1.005009897592350E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-8.864915167552787E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-2.241699914793967E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-2.033470211390458E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-2.279372151931140E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-2.364763548867121E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.530116067098423E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.427852656228018E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.539793883283413E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-2.429066681471138E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-2.246800277701163E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-2.331385419797344E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-2.615690778512221E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-1.484632515882957E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-2.224603682879016E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-2.152903764473890E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-2.096468222946630E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-2.463547940649705E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.151153936071781E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
2.877648344049511E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-7.605061847858204E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-4.274452439329460E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-8.951555576532665E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.095653675562784E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.244199539796894E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.402336394175692E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-2.066752345958976E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-1.386432439180760E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-2.457670060583449E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.154672051474168E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-2.334017706550035E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-8.363550441061619E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-4.562349574398597E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-7.530311043875903E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-2.317334975749560E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-2.904278829233533E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-2.098673945640968E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
3.535356436833906E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
9.157040263088383E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
1.094999800615770E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
8.977941998819619E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-2.189350369893445E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.211568626502162E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-2.693703671604756E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
1.686624946988631E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
7.366494577977561E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-6.818804309980193E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
6.776779478972452E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-3.800321198965069E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
2.825963291916725E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.794398418384408E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-2.697261655628341E-002
DAV: 65 -0.740667992659E+06 0.49558E+06 -0.73847E+06 1920 0.229E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 134.91630 new 133.44612
0.156E+02
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.530562236657035E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.570309749073994E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
5.865644785319471E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-8.279176333439798E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.268839180901989E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-2.402620273799062E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
4.627980279756633E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.065168816258723E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-1.332407529608020E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-1.287416672359145E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-6.750861213820834E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-5.380222660007346E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
4.705637190594719E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-4.345811466069899E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-2.424610866919060E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-4.549466060408466E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.121462035622936E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-3.442681860341587E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.146616345638113E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-2.581470003164658E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
6.992471470131718E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.249881232776190E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-6.185585519591962E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
5.060369113532452E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
2.182341150257202E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
5.176453031318145E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.163322551415412E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-2.102952403107014E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.165429041935957E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.685999563164900E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
2.820184670350308E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
8.586179473741770E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.246569164267241E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-9.913257582704407E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
9.082648185346411E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-2.149206217852119E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.119984684000838E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-7.464767921143162E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-4.323313331917694E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
9.472247032854639E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.025910504740758E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
8.360764720289737E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
1.214479474033403E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.010510680996523E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
5.123137848053653E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
3.273701813804430E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
3.192936704281467E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
1.688392648136005E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
2.494309342292254E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
6.240531640835972E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-4.395194122280696E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
2.569973774369544E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
2.668288043061688E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
1.771102051011669E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-8.122265920198671E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.098562617870947E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-9.633370917088933E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-5.446516846517290E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
7.884414704596477E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
8.476848386702656E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.326352153538913E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.441386694612272E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
9.160069736108695E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
1.174987963738184E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
9.465993289296950E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
8.377655606795334E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
1.738450023709558E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.435536475531541E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-2.098489165578827E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
1.017653293709799E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
2.040311344551671E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
1.112114291082699E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
1.091086043833833E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.456376359262603E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
4.957374295430126E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.406005998900977E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.125612237213545E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.926024091049013E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
1.301379148014106E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-3.912721518661178E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.193263027285078E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
1.208931935753082E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
3.212260904450243E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
2.412961511223080E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-7.205657091905526E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
1.211816755676814E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.228709803522602E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.934076854488848E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
1.333276267615675E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-1.314611428849590E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-1.816697037692798E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-1.483953063118846E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-7.370414153987715E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.484460333245233E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
5.179176311926952E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-4.276271398505335E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
1.909053929803625E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.127498391428095E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
1.756149168681997E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.688604845932303E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.665696558706819E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
2.930316804365803E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-5.094360958113515E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.012111612313254E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
5.399416607200141E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-3.348993681470708E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
2.004077814606698E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-3.870933945488683E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
2.179246217669287E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
2.543308601014614E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-6.904729085394373E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-1.719677519300273E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-5.078184990980931E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
7.799817480254943E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-5.451732078333983E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.260025667329357E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-2.569070414595589E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-3.133499084254780E-002
DAV: 66 -0.202446576228E+07 -0.12838E+07 -0.19767E+07 1904 0.210E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 133.44612 new 131.34837
0.423E+01
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.492287519482871E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
5.953524469593081E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
4.523679012155671E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
2.526562651193239E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-1.292406657488064E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-9.919387334283150E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
2.409512116881100E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
1.684687105378512E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
4.228151634714785E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-3.636273892457651E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
2.920482813515898E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-1.296948110340890E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.064875963899008E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
2.047590053028134E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
3.925992238364174E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
7.268907721812952E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
2.183350840866053E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
4.571734439108035E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
2.269905992388137E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
4.812614172307098E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
2.338355281239926E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
4.943086228228128E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-1.775550555274721E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
2.615226383962436E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-5.141922737257049E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.863501696866313E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-7.626719291857115E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.480231933379683E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.771117000921515E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.455704605463461E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
4.218499386009770E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.832486691682189E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.008222851309645E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-9.782218892266154E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-5.469450604964288E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-5.816215452870274E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.271550232909500E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-8.792301370978094E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-9.304411881217349E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.493590749253544E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-7.170027565627030E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-1.099795613725362E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.701302944586267E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-2.082446504543307E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.158813237473105E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-1.499586860700955E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.946937764399573E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-3.050968674487974E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-4.392714993168458E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.223594409875952E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-2.104154891176067E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-2.509577738234913E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
5.443487854649693E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.732806483689399E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-1.744231738144023E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-8.894474616958603E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
7.764976294455890E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-2.636428007379438E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-3.998269216115799E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.497720490814181E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
6.210229801907507E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-2.259165068224704E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-4.502228143805840E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-9.071909967441260E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
2.251935419386096E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
1.089018155798404E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
2.386365035333814E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
1.530474489659343E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
9.538044926308961E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
3.977407636928046E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.818424319001005E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-2.887193294413607E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-6.082405515314399E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.209706123527160E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
9.654945353852451E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
1.192515751247613E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-7.626862504479611E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
1.173268428657292E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.173401392577556E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
1.649401895535307E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-2.174331237679841E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
2.240076497955794E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
1.935039992303643E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
2.793558516864924E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.827032361920665E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.266037688490499E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.504154062703991E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
2.545203375457577E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
1.733498169640165E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
2.244106322460878E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
3.735972722517461E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
2.495135942638853E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
2.621407464236000E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
4.475733844151213E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.502509704588863E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
2.217529057266503E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.094750127470760E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.511717734142211E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-7.823593663499646E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
1.358890726554752E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-5.986049221833870E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.374914679905058E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.238393230994084E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.580027576101575E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
1.792602318533166E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-2.457553966591073E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.464020289626247E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
2.195698748684096E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-2.877386123035569E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-1.804307818879184E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
2.407794200958354E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-2.699589560408440E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
2.447981342551231E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-2.238782256828811E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.151816560322116E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
4.543404397308805E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.714569072146199E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-1.519084741783996E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.786403914360989E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
2.303147500180704E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
5.926928950778782E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-4.394621373423332E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
2.164065847036648E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.988368234395781E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.346563603643008E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.461052192864135E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.829169867294995E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-2.621465022302118E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.245436881290965E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.693135513073897E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-2.629557317039171E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
3.220613182503267E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
3.136120776953726E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
2.087443807902692E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
2.760536163920259E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-5.479060564320431E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-7.412568701413969E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
8.553828238370290E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-3.658555846517646E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-4.069588783642651E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-3.283190797503730E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-4.768662635203829E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-2.985253183602729E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-5.126182257768703E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-2.820920444293936E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-5.225879742989568E-002
DAV: 67 -0.226761424490E+07 -0.24315E+06 -0.20187E+07 2064 0.215E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 131.34837 new 132.52551
0.666E+02
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
4.986765286928893E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
3.863198404116776E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
5.897154078341756E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-3.092573576651003E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.336355585840337E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
9.108887924302055E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-2.428588772423505E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
2.469539991168406E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-4.221172701701888E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
8.719745596826796E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-5.880906637479800E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-8.991689879831507E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-5.154989513440998E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-4.646635940708985E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
1.873107452512147E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.619537589663776E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-1.419781121588521E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
2.691335180396700E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
9.564962916596604E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
9.950794946192035E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-2.768800016503967E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-1.497396238320891E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
2.568728240089177E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
3.329501141508530E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
2.185754761327435E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-8.281450320665563E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-4.616224653536677E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-4.263052838768886E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-8.349124983346424E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
9.374089240861569E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
2.241416268735181E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.225494128193111E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-3.502647362102510E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-6.646606671670750E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.686325179075810E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-4.572679666694745E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-7.653813595877285E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-4.357813216347505E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-2.486229942872235E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
1.665189195255281E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-9.665596718276302E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-7.767878289571758E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-4.402496812256408E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.096326199953556E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-5.017330775949363E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
3.367531513883349E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.750129757541235E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
3.289014883780479E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-2.625751390919308E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
1.234644277588681E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-5.513884471373215E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
5.160494870849925E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-2.455859797427112E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
3.583738101465838E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
4.697013860650870E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-1.283704494980165E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
5.655668545597477E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.229335541655089E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
7.129684422619540E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-2.946099951154586E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
5.949837060518213E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
6.998456414989185E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
1.106732359788479E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-8.311955422067831E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.195623548744089E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-2.303302066322270E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
3.537828099484375E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
1.240517587984762E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
2.013476349905615E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-1.677399239134098E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
1.524117568278144E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-2.773383558171676E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-7.664561903319440E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.013298722238688E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-2.439418533285748E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.757815629625497E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-2.430316782575882E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.998159356540479E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-5.598656843597382E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-2.732076645196374E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.583461744617567E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-2.058127868953063E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-3.100975319612844E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-4.594401131663432E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.346613188408539E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.614246216796437E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-1.944408247032224E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.117574069210110E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-2.272957978469189E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-2.138113350486626E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-2.170786132246906E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-1.624928418882942E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.689063449352203E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-2.047595762239435E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-2.437214368349066E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.666014060372782E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-9.290854957675888E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
3.679612181972140E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-4.309997569168263E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-1.149525832509174E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-5.862796893240154E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-2.569545856368638E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.394453289862244E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.464614785124501E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-6.472723534071636E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.428415716650632E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.856992647276302E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-2.296986181182691E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.681037644685794E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-3.763495801728035E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.444008287141208E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-1.020035756184749E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.637686874839094E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-2.000517803956445E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-2.467091281414751E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-1.917472268493355E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.504065149451713E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-1.041629783970693E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-1.437487209434010E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-2.010333063167049E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-2.393564943914870E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-1.916680085778312E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-2.048728064112340E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-1.757198375130336E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-1.844264783451738E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-1.630914016251576E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-2.490858230477457E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.324912140672048E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
7.058228487401713E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.943971815454876E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-5.196055398821386E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
6.310895263509747E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-2.691211556911925E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-3.855128455523525E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-5.166282249125737E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-7.719297666995682E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-2.010300564490287E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
3.007867321965341E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-3.829052093276596E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.630777077423043E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-2.081536537329890E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-1.236787105189160E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.035531414321742E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-1.448982580718749E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-2.332511172333524E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.995379317700606E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.932395099242398E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
4.107161676970051E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.906880737661974E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-1.451587657659402E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-1.438917826509900E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.024338261908495E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-8.410593966024352E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-4.983816268413782E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.951860669363837E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-3.464035426758159E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.286643984369964E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.189898062636583E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
2.785166682529254E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.822188941046560E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-3.228652763431850E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-2.582343925669138E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-1.566158589264919E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
8.378696935451948E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-2.621678205514403E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.588192106029288E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
2.004316233283662E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.352122577705336E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-1.796780443844161E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
5.270508192722006E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
2.172079985707715E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-5.435096873803199E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
1.471306863190410E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.503192405128499E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-1.322895075423617E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-2.684114460321219E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-2.063663951671840E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-2.561622827476050E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
1.331225937623068E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-2.429193276213834E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.253673485088234E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-2.075791301997144E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
3.286530728781393E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-1.790785971252328E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
5.929257467637889E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
4.320178170294101E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.752801750713445E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-1.731858770736232E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-7.742265263732294E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.861519139141307E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-3.017565545095972E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-2.788725831171413E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-2.832562314092314E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-2.252700683459483E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.685859849694846E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-3.700136671016030E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.930670772552717E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
2.769617864716409E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-4.668111992503093E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
9.470384705976515E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.192409258870574E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.788016998429408E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.150084170144781E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.386239094016947E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-1.339914630086784E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
2.596699811687889E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
1.721607165041533E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.159777412888618E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
2.000994184013064E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
2.025089226697863E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
2.879750644663080E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
3.952421060934496E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
2.226760935633294E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-3.478757539567744E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-3.090100519247376E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-2.006650950856509E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
5.357479287203700E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.901950343539703E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
4.352958559664282E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.868364917283615E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
2.476623603739709E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
9.524908396542875E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
1.097476339153768E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
4.442529099647144E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
7.317804519016047E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
2.404550974885308E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.792698042445904E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.701887839687893E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
4.472538627046312E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
6.475106097861928E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-8.412762844945065E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
3.064412104442816E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
4.953977663693807E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
0.144903132596813
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-2.056910291126401E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
3.012846626022748E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
4.121876610055364E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
0.117102258939901
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
0.215537432633536
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-4.367630740243370E-002
DAV: 68 -0.266496137201E+06 0.20011E+07 -0.26487E+06 1952 0.449E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 132.52551 new 134.52161
0.103E+02
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-5.855957219344516E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.724725937408890E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.662302439027193E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-2.894204142735560E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
7.407116304396701E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-5.895817341181659E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-4.651108148964223E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-3.658415294284617E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
6.760758220539042E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
9.987112461999820E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
1.128577690245512E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-7.245649906968707E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-4.360709726651912E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
2.845565248503009E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
2.492896311501255E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
3.855609688305854E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-2.600497762660880E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-2.542866056987363E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
1.808027902146416E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
4.509179179697108E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-2.374185233770436E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
4.959222502151964E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-2.098875078851583E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
9.694238238842680E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-3.578537543451513E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
7.970416545194102E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
7.253909889851516E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.221156419056904E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.272150412630234E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
1.304832214594563E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
1.266230667628266E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-7.746489270600345E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.192831210703929E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
1.871901626507726E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-4.458110280382527E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.008144875471476E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.039232446511666E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
8.582077982006123E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-1.135985813479568E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.802561116620577E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.770958362271998E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
9.909015562176630E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
3.593463925489438E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
6.847283565648799E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-6.843353808932811E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
3.669645348641554E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
1.878103565671528E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.993508554679850E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
1.334887387257830E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
1.155622920796679E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
1.820512339606026E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-7.540143843129557E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
1.298878781900427E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
4.521994491641335E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
7.621027859982699E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
2.175708987098514E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.246921018680268E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
4.363330129171814E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-1.938982322479305E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.044457095231757E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
3.026647631515569E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
2.286265596695632E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
6.288365036204419E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-9.589766327995306E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
8.368238925621693E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
1.185293934561414E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.228961154868983E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
2.585101480474113E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-6.728988453284219E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-3.240375428640518E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-2.279801868941541E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
4.326559856077024E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
2.193436698425932E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-9.170821357655161E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.123048397027386E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
6.374808970755425E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
1.484205469652115E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-3.348385216790539E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
2.234898326786370E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
3.042649498301639E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.282532898716940E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-9.107461990378153E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
7.902236430644780E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
2.990741593966790E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-1.312378678428257E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
3.898580400674606E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
3.520593044150459E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-2.985085812772675E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.266098794224901E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
5.639595195059426E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-1.395413851831553E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-2.315539980487584E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
2.077466207770285E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
3.621816871384741E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.722850709745204E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-7.751246590041436E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.918218096148020E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
8.790150156414794E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
8.154659991084624E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-9.798371580506017E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-4.982921430592958E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
3.394701101111493E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-9.226690318794046E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-5.974972854011934E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
1.572807909843866E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-1.852876663778726E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-9.729761854905610E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
8.943786878247026E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
3.117694663783678E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-7.253530822243348E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
3.802839169193822E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
9.441386827473430E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-5.343647412852271E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-8.892825452662856E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-2.033156147819417E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.817029924865031E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
6.896017797971713E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.577551876612508E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
8.299495726152278E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.445377561198705E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-3.612228839437380E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
2.052006925363128E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-7.229433826252411E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-1.093266204023345E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-8.655763159948184E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
3.825230842005036E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-8.298959998587593E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-3.832500294029190E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
2.181533751895051E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.446809508974185E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-9.065278730699271E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-5.251429829051231E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-0.135242641855333
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
3.056852578329728E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-9.629749259548895E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-6.447943700409990E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-3.275196582090367E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-8.655579809207900E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-8.298167015794652E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-0.165621337321769
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
3.142264858185496E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-9.209141658061354E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-7.311097497052711E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-2.160431338687559E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-4.710420159024918E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
4.251422832597886E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-5.017368120974541E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.427468656021986E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-4.804268675711314E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-7.379405305775645E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-3.933978019963753E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
1.327425998312915E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-5.366668448215642E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
5.816753250749482E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-7.053753747355105E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
2.464037977050593E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-5.454935495452741E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-2.258807904438307E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-0.149645645227025
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
1.222193111706459E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
4.148750725079698E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-7.169749762420283E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-2.978847334917826E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-2.037748245418117E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
1.296923364697911E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-0.150341374710476
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
1.362845256612625E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
5.519855309499178E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-6.635039733531940E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-1.822401187773154E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-3.204306718750610E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
2.087337593734894E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-0.138869798545633
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
3.554652442035729E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
6.365363661669211E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-5.675297078533684E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-4.089741878498789E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-5.241911660513789E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-9.305451928136581E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-5.693165152200305E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-2.021611656226875E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.577818641847059E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-5.080407527386923E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-2.660648665647891E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
1.364037403041949E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-2.396608585922195E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-2.465019047258683E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.245367990146921E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-4.575306879397585E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-2.549306756501614E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-0.113873867332617
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-7.288844191110216E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
3.956355524564825E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-8.377014247512685E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-7.742126564122617E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.851235489148866E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
4.272559971465580E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-7.817470628111027E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
6.760610471224688E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
3.120164066778207E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.237920015204328E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-9.380172199680344E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
3.370268887111372E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-8.470086295195668E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-3.834576850512370E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-2.647296667058139E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
2.673335454947277E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-5.009898340863197E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
2.929362318322260E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
1.710922929403951E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-0.121648814814880
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-0.101644883476173
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-5.696070140084258E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-2.371828035439031E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
2.341899247028997E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-9.382405287750124E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
2.205652963855737E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.325247321617742E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
2.707055608165900E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-3.047143965061525E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.245730043153434E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-4.570138506896343E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.593915112591393E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-9.473070129760825E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
4.525678830698035E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.320054082979268E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-6.173895948976998E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-5.414922910877630E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
4.712652877202104E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
2.124642637046643E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
2.205173398441879E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
3.961079432919033E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
4.660457775424433E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
9.309390439734264E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-0.109188205685434
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
1.597413673022075E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
3.113020299503825E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
4.441885187035249E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
9.950640705143594E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.711966749773974E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-2.831872311402771E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-8.032491063869408E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
5.593606507546246E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-1.048539574339784E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.996207849760786E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
4.766030012972339E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-1.897187994236677E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-2.173986432260873E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-3.025479501282229E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
6.417543262065186E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-3.071005719645632E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.023045365807418E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.063097037825247E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
6.060790989929016E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-3.968053541376904E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-2.843691847379011E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-5.179418894285280E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
2.001334931318844E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.789224087818355E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
5.985349506697502E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-2.946383492047766E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-2.099199071871196E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-3.678944310997389E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
2.480149755690823E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
5.914350436873007E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-3.195040969945570E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
3.198204063323271E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
3.006579265260252E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-4.348922414783976E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-1.189307298147752E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-6.250270986462740E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.426282518797770E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
2.087401999223859E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
1.295954559721875E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
8.237055448557276E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.932103558277504E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
3.004812714563314E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
6.939195555352563E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
1.606081946775845E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-2.351413886554651E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
3.773496979952013E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
6.906868182288703E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
3.211160793812884E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
1.747852764216754E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
3.233702840890002E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
5.313398025468630E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
2.429765704572583E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
3.991135394062403E-002
DAV: 69 -0.335585939825E+07 -0.30894E+07 -0.33118E+07 1904 0.601E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 134.52161 new 133.62158
0.304E+02
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-2.932581613788917E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
8.503089286275367E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
2.017772767496155E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.395709617057672E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-4.276105614300177E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.403750097379199E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
2.946164763890124E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
2.036269765860434E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-1.690306684019062E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
2.795849854923592E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.064342673015837E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.766166594855440E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-6.000685945808298E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
4.454577075590935E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
2.099256725393674E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-1.990352196952364E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
2.721270081730542E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-5.519081543168370E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-2.179077291851435E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
2.748535917586021E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-1.602528194742841E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
2.928702396850192E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-6.954484570771254E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-1.969855915966820E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
3.967627432862467E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
2.302698016634409E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
1.212916028641493E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-6.850823161579818E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-1.737935207553842E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
4.672245477630728E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
4.286719408952949E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.136732685396112E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
6.056050089013950E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-4.570207411023544E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.884610959468580E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-3.592043888812816E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.053793738913872E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-3.601809856181330E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-8.537510283379277E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-4.240705098250941E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
4.262516919299136E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.371250899970524E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-5.131268645037140E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
1.233578827859151E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
4.101861937301490E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-5.411171649066202E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
4.669060174741513E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-7.341192633915876E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.622837438079581E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-1.496445834500213E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
2.261764454426878E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.418420306800299E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-1.158269250022193E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
7.225629661298121E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
6.652385551991795E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-3.896061841034634E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
4.409000864350979E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
7.810756715543143E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
1.196605587282052E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-3.996060134512410E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.280209054297630E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-1.189625665474587E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-9.201217877305991E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
1.689661064224166E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
2.289279432457351E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-4.499574883193844E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-2.466564645552346E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
6.206827200485202E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
3.803711584958123E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-2.828895912528086E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.549117011536258E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
3.761175731849569E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
8.118821496407949E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-6.131439059084946E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
4.650546888443233E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
6.455868330740775E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
3.039984887387656E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
6.984971783587517E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
6.685747361334806E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-2.205249002540194E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
1.199858489963176E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
6.075748798390287E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-5.819713829632943E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-3.242634771956805E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
7.954991068566185E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-2.954428007115047E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-9.850021887437097E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.957921687149194E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-3.331752032905378E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-3.959376577625374E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-8.867592775832444E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-9.742192134667278E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-5.730851209275588E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-2.921209462666960E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-2.022466357332324E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-0.104279854119208
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-5.039552727465715E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-4.661363985506332E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-4.987087106990309E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-4.933283946562519E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-6.264800691976227E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
1.647524596256845E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-2.154913928700415E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.951806599716771E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
2.744689130789693E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.505744037224710E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.307039493283031E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.503205260751691E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-2.612761077600968E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-2.789151613850870E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.513177712849086E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-2.540351135289501E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-3.731743223533688E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-4.266692363794396E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-4.995634367764067E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-2.740367676599455E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-7.742933548381445E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-0.115098292398041
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-0.101174129120037
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.949462584098421E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-4.815246794039730E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
2.411185134536649E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.570075605020385E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
5.387680096599663E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-6.189029774131976E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.773802228595219E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-3.187859752668108E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-4.196891544569650E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-3.669385680892751E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-9.294863905959331E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
1.209140006804549E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.257192420012532E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-0.127981516019462
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-0.121434931596327
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-6.175217966693507E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
2.309788793468021E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-1.694626811645208E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-2.236580597845323E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-2.104813006257517E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
3.595090710326065E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-3.748286213752650E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.774257716172530E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.928916801108825E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.664940293486641E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-3.516967994624279E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-4.243521172299200E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-2.651469391042624E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
2.441153718372525E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-9.145289634588100E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-1.552423085545006E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-0.105168063180925
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-0.122292164253164
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-9.746547437116199E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-4.608360087981007E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-9.566292640140985E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-4.188616699612437E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-2.986076648492921E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-0.159741708267663
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-0.169272032944685
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-0.153012904913705
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-3.731580481137791E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-9.365801721945206E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-0.154747286760358
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-9.758602728461707E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-6.793487329206116E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-0.194767200021506
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-0.193729324928851
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-0.188325826078150
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-8.127992848334954E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-0.142591833297379
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-0.198736459749839
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-0.138354839284014
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.325390730568526E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-1.075597456567328E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
9.752247500143327E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
3.245950095746939E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.242417185715986E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.683303351064869E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.529619231380283E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
2.586012739591140E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-6.434231712090656E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-8.221903754696907E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-4.672866751739441E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.475585319666683E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-3.508826085763728E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-3.071257210915027E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-2.134871648692445E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-0.151182369382887
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-5.564570418912104E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-0.124213364600061
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-6.493326058310535E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-0.102637104228786
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-8.658954844090268E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-7.352587681664956E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-0.212304761740303
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-0.106949344540030
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-0.183089999129543
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-0.117685208695451
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-0.166068115077193
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-0.145670770865409
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-2.884978444201319E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-0.117672631471420
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-0.248727963040186
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-0.161261683523697
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-0.225578261373345
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-0.171669932448375
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-0.214952241439429
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-0.198759094563717
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-6.082873254508013E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
2.025240574580043E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.271479498067350E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-3.576205149119301E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-2.508444631090262E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
4.535445529263476E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
6.492948469335280E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-8.709955634258375E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-6.740657164572721E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-8.959058801789158E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-4.653471277797964E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-6.590761583216372E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-7.157970428724597E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-1.106480374829637E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-5.623290946830076E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-0.141140969350960
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-0.212305979498893
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-0.122559886620287
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-0.129114164217942
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-0.182560684770924
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-2.368905890712981E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-6.502690735370115E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-0.127859595280698
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-0.201630591254485
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-0.258488362650454
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-0.184416610792868
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-0.191373081192570
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-0.232341500556377
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-5.654545759098293E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-0.126864490610432
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-0.191193886557709
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-0.238885390208186
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-0.274333844046404
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-0.226795737286287
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-0.232664079447639
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-0.251365427837425
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-0.106273674894644
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-0.169776575503398
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-0.234297241010578
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
3.213885240239290E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-8.785574952161135E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.690038169658632E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
7.080580540894486E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-2.743936815218292E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.820357193241247E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
3.069669623583952E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-5.620463032053305E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-5.317005424107837E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-2.772187206631032E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-5.352158400303478E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-7.402070219952034E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-6.616961722422252E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-0.114586667702652
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-6.897831490929032E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-0.145205047049173
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-0.130022901610731
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-8.865028602789256E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-0.115433874435077
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-8.838566690784322E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-0.145005745053146
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-0.194157432712037
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-0.169224833814996
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-0.203899103349133
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-0.194675386381660
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-0.154127012730426
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-0.167896495942992
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-7.016060612594666E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-0.200409275656529
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-0.233009086838318
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-0.200999149826167
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-0.239933889490504
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-0.239730475357898
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-0.208687348401826
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-0.201477258222829
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-4.797493475019514E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-0.232413551094395
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-0.245930557855401
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-0.214159694943093
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.762074213029344E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-1.359029210088027E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
5.219211204363373E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
3.495286085738615E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-4.614767817514479E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-2.545664651313296E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-4.839265574069558E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-5.431363472165247E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-5.265955480713256E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-3.430101949391199E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
8.744290659532699E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-4.085168019672573E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-7.992845416090796E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-0.148953314747403
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-0.107446964569353
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-7.678213745601661E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-6.972028126990935E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-2.999433225372882E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-0.217050994202932
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-0.160432949174991
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-0.109783493838583
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-0.144746222743083
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-0.253400200885968
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-0.203458688902842
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-0.136934336541461
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-0.199700827125609
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.129321501025798E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
3.255439683183786E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
2.063854615144378E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
4.353198992672245E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-4.354037798607159E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.843732045837878E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.107658468986022E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-7.297937999319054E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
7.195117755616084E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
1.610791249306473E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
9.778921562124837E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-0.104968678016652
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-3.012332405090519E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-0.122996870567522
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
2.356605917556163E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
2.446988379065165E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-2.747930949684963E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-0.124861571764954
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-4.916050853327613E-002
DAV: 70 -0.344218390900E+08 -0.31066E+08 -0.16856E+08 2000 0.291E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 133.62158 new 134.53025
0.247E+02
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-7.369576546813746E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-3.366151198202545E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.278540725081508E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.112777585148874E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.199357901280091E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-9.089800008189326E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-6.869719845237400E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-6.729781206941986E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-3.177905631261887E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
3.834531377112253E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-9.982293484182521E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-9.709450855586897E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
2.445626619871056E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-2.023709020924587E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-1.359153939680818E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.694676716759785E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
3.887199282748413E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.779107593936777E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.383322834023746E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.348573064193207E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-2.342860193784224E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-1.230749864674620E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-2.132063242146120E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-4.238215136867690E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
4.990949763641090E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.317382371098538E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-3.050122936521614E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
7.924214787634345E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-2.198660189448457E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-4.160196236047657E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
8.265866118355546E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-4.632327467922378E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-4.327632564745314E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-6.597237056021344E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.935172191641579E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
1.952554701990830E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-6.177273117509283E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-3.239240940978313E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
3.059942561574624E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.506989729090846E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.904799080318472E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-2.578137090096171E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.785911784813820E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
5.398200741782426E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-4.701607731231419E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-6.958736774025108E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-3.807384946725628E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-0.121543601921472
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-1.690503416136160E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-4.454304970190887E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
4.405525114974347E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-4.255414932337284E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-6.392510923377497E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-5.697219166073128E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-0.114790359858914
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-1.337269180968588E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-5.211552435782434E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
3.480040126928566E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-2.949781550340493E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-5.347476966542462E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-5.549987885427170E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-9.986343762758021E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.002568625603187E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-8.938806753286406E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.140584638865532E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-7.300040455114915E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.677613392598884E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
4.924684392142624E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-4.424294801041123E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-4.952243038421241E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-5.531368465484019E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
2.347020170193875E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-3.014397726171972E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-7.032181756081730E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-7.250222123997010E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-6.488395334267959E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.763330919540744E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-0.123035458528603
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-1.718423145465745E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-0.106947364773118
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-0.182312250712050
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-0.148347547878320
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-6.949475110017150E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-0.108425031650755
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-1.539825784049616E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-1.824310039681780E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-9.095653146517108E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-0.172003576295227
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-0.139464514954461
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-4.443716719587567E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-9.231129961532049E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-1.811852934711528E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-6.584867988585438E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-0.160032606159268
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-0.117760716912105
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-2.124775580944669E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
4.177243205854976E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.727680872157646E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-1.103110594963091E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-6.904725447467251E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-4.022602194758533E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
4.026848427740556E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-4.346089358127327E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.606444030264373E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-2.782757221535152E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.869340484624775E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
2.151615767053019E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.683044860392449E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-2.405855193167816E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
2.628569267197905E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
2.403980538191895E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-1.502431193836751E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.674767041632614E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
2.784141312620224E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
7.423330872511186E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-8.592983572631633E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
1.428795067703733E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
5.875953935743688E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
8.227264719463499E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
1.753245233420385E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.231274320668143E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
4.101676604100084E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
3.941375303963488E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-6.883965972366524E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
2.231955503072844E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
3.422517711319861E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
2.321204372564480E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-2.236271270013496E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.516362242246615E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.464620930184367E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
4.287659453926880E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-8.168105311900297E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
7.455180593144880E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.334789529764379E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-4.647212403266265E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.219113847620201E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-6.714212984640081E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
1.159813285366381E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
3.935568124080960E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.071924549565509E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-4.068353229314085E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
1.620476964263822E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.092781151996925E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-5.804818124598241E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
6.533557851769481E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
2.239646140246037E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
4.461008917180125E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-4.316639854354504E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
2.073991051509756E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
8.181053254268841E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
2.516424188791958E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-0.142491925041869
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.549717384734186E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-4.330224069502701E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.529521376585250E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-4.014211213112260E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-9.281490115077705E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
3.033362227113645E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-3.702351695609341E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
6.522465452079503E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.893018641755400E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
4.140832966116052E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-4.375060260630156E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.469817337275132E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.311191147374988E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-3.861533397143025E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
3.774063639790219E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-4.749142897778120E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
1.841212066075398E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-8.248926610991383E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-2.465762056903585E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.833440925382574E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
2.121898174840498E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
6.643000881596912E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
5.098277204990273E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-4.323159952966003E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
2.098395206878344E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-5.319919658776194E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.600621555022802E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-6.766573381048242E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-3.125525648801319E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.081506645589891E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
2.572279483191083E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-3.449100214820876E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-5.652235349305507E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-2.278921780755784E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-2.165124481254059E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.260157909048829E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.488403788885011E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
6.780809965057895E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-3.262967513807644E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-4.629148405527527E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-3.163927800246800E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-1.114082699046835E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
1.624969377127770E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-1.438522143651751E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.678330145117193E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-4.465912087998797E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.029656634006982E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-7.435746381113075E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-6.921718528051636E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
8.013559468848809E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.650909311748894E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
3.332975322958596E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
2.055770652988029E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-5.219077559020027E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
3.588646992619740E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.804615180419105E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.437783097798032E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
2.131125951546839E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
6.720710901817624E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
2.185423261865009E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
2.591235807979339E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-1.748317666813323E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
2.008929224413089E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
1.993160379439073E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.985211552441698E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.562644154893783E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.789862881566691E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-2.411990639224090E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
3.803270138209562E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-8.686839525799257E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
3.184812687145413E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-3.435669862902982E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
3.411664207895448E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
5.081951046544282E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
3.311830284168668E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
0.100242659556593
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-3.446967495494681E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
2.407599412337023E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-2.633345691832152E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
6.270973768275078E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
6.958283162807086E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
6.164494563949084E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
3.647395893949038E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
9.678255087049646E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-5.545922828683839E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
2.748656156639001E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
1.994390301630185E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-5.093874399094195E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-7.423082869954079E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
4.591999767998355E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
7.648122165500635E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
8.830068295557551E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
3.863063555868238E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
9.476304423577300E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
5.406745942800834E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
2.182538910855453E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-5.160471433391933E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
8.532486152753847E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
2.877004243304816E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
1.851011530808328E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-0.105019130648723
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-9.483521999272777E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-4.635546965745838E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
2.419712879513151E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-0.154598286728348
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-4.557259038519033E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.033180479528101E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-1.155660321475637E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
6.204646057117131E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.572582423108328E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-5.774265320761580E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
1.455750573025403E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-0.125904629633079
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-6.078426147827076E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-0.129052859877220
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
1.159508610391920E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
6.315603652042921E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
3.654675635984963E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-0.192284343681209
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
3.539565640565049E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-9.338527764037305E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
3.240136294912815E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
1.945588655162270E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-0.246596141050157
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-4.394668649730965E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-2.092743547130357E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
2.104007869626887E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
2.794320896028104E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
1.784322252688755E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-0.262163024525375
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
2.061419852809012E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-1.281110377857076E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
1.997087517650949E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
4.894831693244564E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.912907076265974E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-2.672995851234332E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.638807270156496E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-8.928316328327552E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.921125500522890E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-4.996315465952661E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
1.173047652523891E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-2.958281867796390E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
2.544254017384799E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
5.957405745530951E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-0.193863884175436
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
1.245417767732636E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
1.479906487179125E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
1.596835307489047E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-3.668607041721873E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
3.739901400674550E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
7.010738917295690E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-0.222250968541477
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
4.630360138816780E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
2.610963705835812E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
1.639175797195371E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-4.186395564973548E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
3.667637238184811E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
7.174017686609190E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-0.214350021515537
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
4.041356616258902E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
2.700334583507915E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-4.650698601358717E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
3.620537631710017E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
7.352753896063753E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-0.206852886381599
DAV: 71 -0.465050596826E+05 0.34375E+08 -0.22775E+05 2120 0.293E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 134.53025 new 133.05623
0.278E+02
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.884032656444347E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.459953482561465E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
6.524727015759904E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.427890542510184E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-5.540957996116621E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-9.166630136669217E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-4.166684111899893E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-2.902973207638410E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
1.424957346291117E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
1.690168075278391E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
6.177519282494098E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
4.839510319309798E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
2.425919312672953E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
5.200882439723500E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-3.868105086579721E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
5.628686416617985E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
4.609015027425117E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
5.282694739971512E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
9.386294299685594E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.755485718691370E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-8.685294967396974E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
2.374569426558821E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
5.945079565960473E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
4.235584122258586E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
4.803544060498753E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
1.037104035264529E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-7.836663072913619E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-4.568997642254985E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.313740244035462E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-3.490482827918215E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
9.184554437058030E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.212678875632278E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-7.018121769273573E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-6.802351358263778E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-2.441386505495914E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
4.898076841974621E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-3.701621795360219E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-4.966910793285839E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-2.184062291657748E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
3.995767169278876E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
9.530824743798549E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-3.306481071635901E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-4.528703621040619E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
6.767811880122805E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
7.813544398034387E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.429714944668894E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-7.788795776510714E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.034497844846532E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-1.332396835577599E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.630421638121044E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
3.605563282037091E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
5.030285063946592E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
2.217865424732397E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-2.789881757157872E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-3.759844550926361E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-5.253873125795522E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
1.227984408725510E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
5.051861822118816E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
5.537450096518422E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
4.400965191280448E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-2.864063561656669E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
2.257843329276672E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
1.474557809143233E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
3.634727265352583E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
1.442159022762352E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
1.636976181564303E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-1.872213966633190E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
1.213908741424148E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
2.295312992973314E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
1.577192379223584E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
3.383160947144571E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
2.141445737830751E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
2.170233729346947E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
2.031920873888786E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
1.510778221710169E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
2.062411158088736E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
7.640765854078212E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.955810475129509E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.212815257537601E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.226013399998314E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-2.537590367874482E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
3.959872168499920E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
4.767874033809863E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.257443190540922E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-3.234707678276780E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-3.276081887008953E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-5.978446728982996E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-2.343471586901152E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-3.703888325319241E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-2.438668462633713E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-7.189918183898991E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-4.725126723936276E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-1.114486944001347E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-1.634172939518554E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-3.551651851740886E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-5.323371211737021E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-3.890720078530005E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
4.227445121979983E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-1.733384194177978E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
5.271755509165715E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.154257495739785E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.387496697476683E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.005688388326810E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-5.454740304199135E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-6.630258119236190E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-9.108485069378967E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.526407975172888E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.432856273985764E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-3.635096811924207E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
2.047867632740252E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-2.325603655678801E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-6.980076593155753E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-9.319675632664354E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-0.130607272615484
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-8.705940170374012E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-3.295051604590654E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-7.340002953744286E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-7.437176412376484E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-5.752010239946165E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-9.025073880785391E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-0.102814947983130
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-0.145767614311351
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-0.107236249167247
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-3.850720515387055E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-8.789187337429356E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-1.082960946426412E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-7.057091931288813E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-0.101583170911432
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-0.109429467194079
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-0.150888958384614
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-0.122882503534747
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-4.066051568540605E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-9.493706819952237E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-1.156175805360139E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-7.355359154791341E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-2.101490019012503E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
3.934650521462675E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.195010583296016E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-9.440490692345296E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-2.131329095470459E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.450169351276109E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.669157188219659E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-4.429543486618263E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-3.066159727769454E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-3.087474805956035E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.341191268083898E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
4.855078486988082E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-5.630710550833329E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-3.310785246695597E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-6.116841642195259E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-0.132898822506863
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-7.474952741722776E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-1.685174879971345E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
9.564192407719368E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-8.182566456096796E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-8.504027857733236E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-7.607068940886304E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.345956304193737E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
4.764084253318571E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-3.344949251093115E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.024646412048787E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-3.397978589170213E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.641594216396835E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
4.967730369078319E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-4.679023723164853E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-1.452224926962337E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.609962347720085E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-5.579101153112082E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
4.655488778271377E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-3.567702928565539E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-5.362221079433079E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-7.831789039765183E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-0.140232353129567
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-7.308608241735257E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-1.993425860399392E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-2.391835026544334E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-5.052275425140706E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-6.302726576606933E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-9.770279657033556E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-0.160113803141907
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-0.104311159735059
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-2.530687265210857E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-4.114142242816322E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-6.780013195161533E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-7.957561882334195E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-0.106141431252233
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-0.170184623443724
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-0.123500740205587
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-3.661003701839633E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-5.824356370278254E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-7.682243083621318E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-9.287684992106521E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
5.494245685031490E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.448382618394063E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
5.991644945054131E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.853255080896057E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.713188756198758E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-4.764704458371201E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-2.707339302725831E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-6.589313273316954E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-4.566362871548899E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
5.142652543376719E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-3.806782585283106E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.889170613597867E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
7.158005526605257E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.311949483880348E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-2.729156943671245E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-3.882979794279867E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
3.358659487390636E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-6.462280646401890E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-4.125149115319707E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
1.378800438457355E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-2.642629176320361E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-5.554327270478662E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.885794596115184E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.619773266622845E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-2.467479373861485E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
2.794941127528843E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-2.015699220542251E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.985259832618960E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.887586656846049E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-2.062027393091909E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-4.033634959985233E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-5.935449475230916E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-6.934753931214588E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-3.657878520047091E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-6.480335871052828E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-8.203237297226581E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-3.307702041292818E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-3.453094266197825E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-5.434769199090124E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-0.103248360265995
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-6.033825655914211E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-2.482583552223595E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-5.071887990396631E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
1.268855725393583E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-0.116576843033356
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-3.576503775259685E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-6.142077251308968E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-0.116519356611678
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-5.714347702874324E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-5.971882189198662E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
1.534978936423696E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-0.137635754080364
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-3.554833218217173E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
-6.517680136209700E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-0.123733674450504
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-5.215087624000812E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
3.254838247196992E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-6.681004051218395E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
1.723203875309625E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-0.156900392850043
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.500673572034435E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
6.887143108556933E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-7.252362307751257E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-4.497385329143401E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.715876962191512E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.294566857060400E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-1.507580877703996E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.319575971112867E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-3.933065106550741E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
1.061178342091923E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-4.945049033700460E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-8.724645966205651E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-4.377245280513511E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-3.698790717522422E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.120767413248422E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-7.702483010963365E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.466391011540168E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
4.277447652604067E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-4.770287201484699E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-0.171726063209187
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-5.781372441854429E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
4.599992160854156E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
2.005623619201860E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
1.283676624266644E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
5.605800297447439E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-3.737331152618066E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
-0.182187935165125
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-6.699331965438729E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
7.383445755896648E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
2.457376826367250E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
1.860939895554644E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
5.952932263875138E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-1.898128665420876E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
-0.174843356914722
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-6.367153132153293E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
6.476935222967163E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
2.688770260716966E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
1.893720033073460E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.415741869642514E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.817276467516117E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.186571545810309E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
4.358355136331342E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-3.173075578669769E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.148687091859120E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.050946185668497E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
4.182978783556357E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.304681723790677E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-1.089152673402461E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-4.317452472586424E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.894077819697513E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-4.474897249840706E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-4.489585881892513E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-6.391767277131885E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-4.700903705653675E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-1.417464402259389E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-5.932207985220558E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-4.693213411437350E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-5.001201048862982E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
3.397466852755401E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-2.369320717941241E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-4.207717500571916E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-3.616117204503139E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
3.840190040676889E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
2.005099092343926E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
3.253626021712417E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-1.634929422070875E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
2.319260141469984E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.901228456913314E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.158825689252802E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-4.171950086279233E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-3.000547445330408E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-2.838245355722885E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-1.038637822758889E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
2.941540508978438E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-2.057794453413456E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
3.894001119267050E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-0.121976232328584
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-0.105708939078437
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-2.033916973036616E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
2.534765789289625E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
4.039354787481731E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.730871252853898E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
2.303970162470600E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-0.109670425745662
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-0.142195212466526
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
2.163989812456462E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
1.342863716041015E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
5.923794342684866E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
-5.134216840088528E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
-0.115581999940967
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
4.577367505467692E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
7.599451307590120E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
1.491477066198479E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-1.180202991646887E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
4.040099081448437E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
9.396963392693257E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
-8.739653923757773E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
4.745687232169551E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
1.477185052490351E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
-2.212557249560083E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
4.959236929963226E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
3.484001598574105E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.657835281835712E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
3.274103846889572E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
3.021161127650021E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
2.703679740557506E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
2.472955481584661E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
0.137226487941869
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-3.890231601595758E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-2.847623192960480E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
4.864260467996898E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
4.039745272682337E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
0.122205857102264
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
0.164582819318020
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-7.370342389280654E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-4.185996285936262E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-2.764463779534068E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
6.360716337019028E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
6.250668671688443E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
0.102612979729807
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
0.172842054022331
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-7.477020177305035E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-4.814522248832766E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
-2.303965733279842E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
6.887380457081531E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
7.648433005350999E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
9.331421256678539E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
0.177041560681420
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-7.190116840684092E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-4.938524183953644E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
7.953099208436604E-002
DAV: 72 -0.506221252218E+07 -0.50157E+07 -0.27727E+07 2096 0.243E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 133.05623 new 136.01861
0.400E+02
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.397823917546873E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
3.319725858359469E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-7.943313407682291E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-2.392831208603796E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
8.816667265681861E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.301363855956106E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
4.041551652549077E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-8.751721540362670E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-5.862371780274839E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
5.965663928949161E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-7.261287595473036E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.262651788360969E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
8.239248702614331E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-4.112559095318537E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
2.322466060296882E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-2.173494307266565E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
2.817206489126848E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
2.338056673565431E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
1.434207344297896E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
4.494368233623121E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-2.043272119824913E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
1.136384667365642E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
1.317674356953291E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
3.175962735235240E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
3.018702140813033E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
2.816951043250524E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
2.979885809124873E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
1.340533149806120E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
1.657237614137625E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.278993658242712E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
5.540524415651366E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.904278434255255E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.231100172310347E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
1.124460364694758E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-5.265913517924731E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-7.523766479813547E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
3.120354067472723E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
7.989922368492315E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-2.168222960860088E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-6.514248886675000E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
5.539436536155383E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
9.346085066543917E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
1.301773145021748E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-3.631635643808508E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
2.907747233347910E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
6.792008799530350E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
1.964526282518546E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-3.626380649164380E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
2.345208377050912E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
2.583416349883286E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
4.959160794188225E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
2.919406831481069E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
4.758491357669302E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
3.611034989296467E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
2.378400946190289E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
2.871625994831286E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
3.972239209366082E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
1.549491876346370E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
2.853272479370306E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
3.819548628875329E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
3.597500954443181E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
1.738495290059786E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
2.453886192051376E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
3.076939993476462E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
3.514438552646481E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-4.504913810268924E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.994386659445902E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-2.588074670494384E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
-8.485101262312485E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-3.537371476980606E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
7.708424713284969E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-2.527871749892901E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.901352128779667E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
9.884033505866800E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
2.186452867732088E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-5.302226377346630E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
1.147853207392718E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.245185083856646E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-1.651631648471931E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
3.084213165494907E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
2.584860677403530E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
2.842669537388769E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
5.811693994903128E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
1.800291399591182E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
3.542010677496209E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-4.196091359079361E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
1.456178110470761E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
2.969920185389614E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
2.799437251924630E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
1.313080110639975E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
2.189753520413942E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
3.320097645476549E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
4.647523882934221E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
-4.184832564758496E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
2.678693978370278E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
3.195936257947102E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
2.838881470423695E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
1.472887784593158E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
2.814468048877430E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
4.216670456694190E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
5.106798379091940E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
-2.626825232863944E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.677903526083417E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.463150438773707E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-7.824277812208371E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
2.869239208160579E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
3.214513820799098E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
4.550281075855598E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
2.311697258443109E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
2.240055439881153E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.087728151959424E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-1.614275785874636E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-9.772787024582416E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-2.022206402447843E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.583762586064208E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
2.174761172073426E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
1.970098071659758E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-1.876232530749921E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
1.397152104559273E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-0.141275274595258
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-3.392384498814845E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
1.312760246146225E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
2.073788831106984E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
2.270538711246683E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
8.295323133589189E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-2.059821750708126E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
2.794915538733501E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-3.855229151839332E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.486369170295778E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-8.169361056173784E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.817938154740011E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.403796733364464E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
4.544124296428287E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-1.310019350830959E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-9.429735225417507E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.671026848686192E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
4.079194047373052E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
9.169801921086957E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
1.215501281210095E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
6.835891818508979E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-2.194891911173507E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-5.107638492822200E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-2.892907412146591E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
2.410061454702948E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
7.114827435746493E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
3.365577943919110E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
4.243065405626459E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-6.085183456412578E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-1.918348234023129E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.475882926723497E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
2.167738479313386E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
4.635059448155486E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.092669708125006E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.653305842361762E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
4.910588306361725E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
3.520881546746406E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-2.283379709499953E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-5.706159749255075E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
2.089925238985136E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.910377802305271E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-1.632484533136989E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
2.179628290169865E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-3.905828927046440E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
1.500579658971998E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
2.077623691884814E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
7.479447349048165E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-5.808731195122600E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
-1.905937768038896E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
3.093413298087485E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-3.418401768634340E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-8.959925236221142E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
3.323492400476114E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
3.475569748958377E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-3.763227703363868E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-3.499740124555649E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.809180212930402E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
9.175347835682012E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-0.111090215784613
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
-1.027709369036942E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-1.054271651501899E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-2.383983844967044E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-1.279709131831630E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-3.081011397681846E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
3.474834262133714E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
5.160427766085700E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-0.136379843772121
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-3.719642591470392E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-3.954920028556517E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
1.869885892288332E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
1.553305734875514E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
3.507034262860977E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.556026667201703E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
6.304400133951569E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
-3.176992217615403E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
3.125672995055348E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.197889286603884E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-1.335327739340797E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
1.897809374044104E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-9.048628943385893E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
5.162231302924482E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
3.111789004212133E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
2.690979791458118E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
3.434720135106545E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-1.530256107616217E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-2.284237744692570E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
6.338514605913112E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
6.256359035026317E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
3.859288630436546E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
-1.279366758826969E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-0.165901862735219
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-6.697637589127678E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
2.520686149604336E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
3.639019580957523E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
7.646891481139238E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-2.288268105703265E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
2.000205220234457E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
3.095609938592323E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-2.649012659742619E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
6.718173148219103E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
-7.634407170957565E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
2.380934350024756E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
2.169775806223155E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
1.800436254028418E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
2.254524908958176E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
2.441257686210466E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
4.171012426608561E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
2.758314631949056E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
4.545745578036309E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
3.063733652455117E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
4.077605313241645E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
3.127469487160980E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
5.819970057356778E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
2.774000469305383E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
0.126188862255648
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
3.603492630758359E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
8.518331232723610E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
0.124531858790930
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-6.255672746680071E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-1.246311039541347E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
1.023454608120173E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
3.107840683460543E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-2.466027941990615E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
5.779421839808753E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
2.642337210935061E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
1.519065878861564E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
1.260431598095765E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
2.792091137116555E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
5.602879869607544E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-2.138777987983060E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
-3.636823082306073E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
4.925149559263362E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
6.352704202705889E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
7.863508018126725E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
0.161817143425156
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
0.270328191637987
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-0.149477130296891
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
7.217776925986640E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
8.480479074403111E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
4.426784423163185E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
9.665228948254813E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 28
0.161820001201631
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
0.263914480742932
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-0.118555058485530
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
6.328626130911232E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
0.101095301729514
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
1.796734513989093E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
3.195950007736335E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
0.108593152666060
WARNING: Sub-Space-Matrix is not hermitian in DAV 36
0.153934868360090
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
0.250499122778881
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-7.394936239225597E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
5.281399206096979E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
0.117040884406773
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
9.137234959165366E-005
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-6.306611193290599E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
9.027335465513837E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.097839133338440E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-1.809038216534848E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
2.021838126369915E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
2.630023705218954E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
1.448160255029742E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-5.597358877092798E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-6.478405786896482E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
7.048924031789857E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
2.063351725617702E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
3.738613555617098E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
2.168680468289098E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
9.640154567459128E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
2.322313255174003E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
-2.018249169290054E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
5.197791180422424E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 20
8.642990438281502E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
0.113587304801581
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
9.935933640579671E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
1.421676459373430E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
1.877318208544607E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
1.922573639161912E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
1.140895480329512E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
5.020152101214659E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.764069892592926E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
1.819252804658005E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
8.496643336799057E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
6.449451302442910E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 8
-1.208934418777821E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
2.071022414924583E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 12
-2.686270669322830E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
1.429277261011970E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
4.139419766709990E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
-6.329029754179771E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-3.609583951826943E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
5.596698053942373E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
-1.065610577150264E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
1.442356292906589E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
2.422536035322725E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
0.115078711316554
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
-0.101326657422872
WARNING: Sub-Space-Matrix is not hermitian in DAV 1
-2.267981039410128E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 2
-1.995978289479840E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 3
2.859847127529692E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 4
1.649192365333994E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 5
-3.028788719372927E-003
WARNING: Sub-Space-Matrix is not hermitian in DAV 6
-9.868879540850188E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 7
3.871295149231318E-004
WARNING: Sub-Space-Matrix is not hermitian in DAV 9
-9.589837960285161E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 10
-1.779604509034439E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 11
5.105734335676215E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 13
-3.095254705357540E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 14
-8.077689575011693E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 15
9.081477739150255E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 16
4.307076316731712E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 17
-0.136722669423811
WARNING: Sub-Space-Matrix is not hermitian in DAV 18
4.571566674021320E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 19
6.328164326776838E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 21
-9.753083536523022E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 22
-0.135872170014583
WARNING: Sub-Space-Matrix is not hermitian in DAV 23
0.168845416840766
WARNING: Sub-Space-Matrix is not hermitian in DAV 24
7.309025896520202E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 25
-8.471185421203221E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 26
8.222617599316261E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 27
5.637727959396743E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 29
-0.112015029313078
WARNING: Sub-Space-Matrix is not hermitian in DAV 30
-0.142499073334052
WARNING: Sub-Space-Matrix is not hermitian in DAV 31
0.145922136283836
WARNING: Sub-Space-Matrix is not hermitian in DAV 32
6.022125035347009E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 33
-4.726226237649132E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 34
7.183968616266119E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 35
5.542963131600117E-002
WARNING: Sub-Space-Matrix is not hermitian in DAV 37
-0.148775730584904
WARNING: Sub-Space-Matrix is not hermitian in DAV 38
-0.143009083309488
WARNING: Sub-Space-Matrix is not hermitian in DAV 39
0.138618138095343
WARNING: Sub-Space-Matrix is not hermitian in DAV 40
5.638710152750517E-002
DAV: 73 -0.140578693628E+07 0.36564E+07 -0.47849E+04 2056 0.388E+01BRMIX: very serious problems
the old and the new charge density differ
old charge density: 136.01861 new 136.46315
0.246E+02
-----------------------------------------------------------------------------
| |
| EEEEEEE RRRRRR RRRRRR OOOOOOO RRRRRR ### ### ### |
| E R R R R O O R R ### ### ### |
| E R R R R O O R R ### ### ### |
| EEEEE RRRRRR RRRRRR O O RRRRRR # # # |
| E R R R R O O R R |
| E R R R R O O R R ### ### ### |
| EEEEEEE R R R R OOOOOOO R R ### ### ### |
| |
| Error EDDDAV: Call to ZHEGV failed. Returncode = 7 1 8 |
| |
| ----> I REFUSE TO CONTINUE WITH THIS SICK JOB ... BYE!!! <---- |
| |
-----------------------------------------------------------------------------